2-[1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-{[4-(propan-2-yl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-{[4-(propan-2-yl)phenyl]methyl}acetamide
2-[1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-{[4-(propan-2-yl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | L558-1066 |
| Compound Name: | 2-[1-methyl-7-(4-methylphenyl)-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-{[4-(propan-2-yl)phenyl]methyl}acetamide |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C26 H27 N5 O3 |
| Smiles: | CC(C)c1ccc(CNC(CN2C(c3cnc(c4ccc(C)cc4)nc3N(C)C2=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5294 |
| logD: | 4.5294 |
| logSw: | -4.1765 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.88 |
| InChI Key: | JTHCNBNFNKSVKI-UHFFFAOYSA-N |